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{
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{
"id": "mp-1203055",
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"structure_string": "Ho4 Cu8 Br26 N6\n1.0\n11.022618 0.000000 0.000000\n0.000000 11.022618 0.000000\n0.000000 0.000000 11.022618\nHo Cu Br N\n4 8 26 6\ndirect\n0.750000 0.750000 0.750000 Ho\n0.250000 0.750000 0.250000 Ho\n0.250000 0.250000 0.750000 Ho\n0.750000 0.250000 0.250000 Ho\n0.630725 0.369275 0.630725 Cu\n0.369275 0.369275 0.369275 Cu\n0.369275 0.630725 0.630725 Cu\n0.630725 0.630725 0.369275 Cu\n0.869275 0.130725 0.869275 Cu\n0.130725 0.130725 0.130725 Cu\n0.130725 0.869275 0.869275 Cu\n0.869275 0.869275 0.130725 Cu\n0.777884 0.725294 0.499618 Br\n0.222116 0.725294 0.500382 Br\n0.222116 0.274706 0.499618 Br\n0.777884 0.274706 0.500382 Br\n0.499618 0.777884 0.725294 Br\n0.500382 0.222116 0.725294 Br\n0.499618 0.222116 0.274706 Br\n0.500382 0.777884 0.274706 Br\n0.725294 0.499618 0.777884 Br\n0.725294 0.500382 0.222116 Br\n0.274706 0.499618 0.222116 Br\n0.274706 0.500382 0.777884 Br\n0.722116 0.774706 0.000382 Br\n0.277884 0.774706 0.999618 Br\n0.277884 0.225294 0.000382 Br\n0.722116 0.225294 0.999618 Br\n0.000382 0.722116 0.774706 Br\n0.999618 0.277884 0.774706 Br\n0.000382 0.277884 0.225294 Br\n0.999618 0.722116 0.225294 Br\n0.774706 0.000382 0.722116 Br\n0.774706 0.999618 0.277884 Br\n0.225294 0.000382 0.277884 Br\n0.225294 0.999618 0.722116 Br\n0.500000 0.500000 0.500000 Br\n0.000000 0.000000 0.000000 Br\n0.000000 0.500000 0.500000 N\n0.500000 0.000000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.500000 0.000000 0.000000 N\n0.000000 0.500000 0.000000 N\n0.000000 0.000000 0.500000 N\n",
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{
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"structure_string": "Fe16 S16 N16 O16\n1.0\n10.435039 0.000000 0.000000\n0.000000 11.217004 0.000000\n0.000000 8.058805 12.996840\nFe S N O\n16 16 16 16\ndirect\n0.086054 0.216055 0.544186 Fe\n0.650967 0.752662 0.385782 Fe\n0.819837 0.728771 0.091548 Fe\n0.680163 0.728771 0.591548 Fe\n0.913946 0.783945 0.455814 Fe\n0.212444 0.989615 0.106506 Fe\n0.849033 0.752662 0.885782 Fe\n0.586054 0.783945 0.955814 Fe\n0.413946 0.216055 0.044186 Fe\n0.712444 0.010385 0.393494 Fe\n0.150967 0.247338 0.114218 Fe\n0.180163 0.271229 0.908452 Fe\n0.349033 0.247338 0.614218 Fe\n0.319837 0.271229 0.408452 Fe\n0.787556 0.010385 0.893494 Fe\n0.287556 0.989615 0.606506 Fe\n0.228415 0.411607 0.467046 S\n0.309566 0.073362 0.205673 S\n0.654845 0.897822 0.042433 S\n0.271585 0.411607 0.967046 S\n0.154845 0.102178 0.457567 S\n0.030405 0.138973 0.042853 S\n0.728415 0.588393 0.032954 S\n0.969595 0.861027 0.957147 S\n0.809566 0.926638 0.294327 S\n0.771585 0.588393 0.532954 S\n0.690434 0.926638 0.794327 S\n0.345155 0.102178 0.957567 S\n0.845155 0.897822 0.542433 S\n0.190434 0.073362 0.705673 S\n0.530405 0.861027 0.457147 S\n0.469595 0.138973 0.542853 S\n0.417303 0.756050 0.955526 N\n0.697976 0.196438 0.333800 N\n0.627038 0.633775 0.722315 N\n0.872962 0.633775 0.222315 N\n0.560781 0.682232 0.323715 N\n0.939219 0.682232 0.823715 N\n0.302024 0.803562 0.666200 N\n0.197976 0.803562 0.166200 N\n0.802024 0.196438 0.833800 N\n0.917303 0.243950 0.544474 N\n0.439219 0.317768 0.676285 N\n0.127038 0.366225 0.777685 N\n0.082697 0.756050 0.455526 N\n0.060781 0.317768 0.176285 N\n0.582697 0.243950 0.044474 N\n0.372962 0.366225 0.277685 N\n0.194032 0.681828 0.199717 O\n0.907717 0.568452 0.308831 O\n0.998408 0.631609 0.785719 O\n0.694032 0.318172 0.300283 O\n0.501592 0.631609 0.285719 O\n0.694584 0.258464 0.044989 O\n0.305968 0.681828 0.699717 O\n0.805968 0.318172 0.800283 O\n0.407717 0.431548 0.191169 O\n0.592283 0.568452 0.808831 O\n0.194584 0.741536 0.455011 O\n0.305416 0.741536 0.955011 O\n0.805416 0.258464 0.544989 O\n0.498408 0.368391 0.714281 O\n0.001592 0.368391 0.214281 O\n0.092283 0.431548 0.691169 O\n",
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{
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"structure_string": "Ba1 Ca1 Ce1 Sn1 O6\n1.0\n0.000000 -4.284501 -4.284501\n4.284501 0.000000 -4.284501\n4.284501 -4.284501 0.000000\nBa Ca Ce Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Sn\n0.741820 0.258180 0.258180 O\n0.258180 0.741820 0.741820 O\n0.741820 0.258180 0.741820 O\n0.258180 0.741820 0.258180 O\n0.741820 0.741820 0.258180 O\n0.258180 0.258180 0.741820 O\n",
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{
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"structure_string": "K4 Ge2 B8 O22\n1.0\n6.121029 3.422805 0.000000\n-6.121029 3.422805 0.000000\n0.000000 0.306896 12.025585\nK Ge B O\n4 2 8 22\ndirect\n0.440193 0.527310 0.890703 K\n0.527310 0.440193 0.390703 K\n0.308470 0.813312 0.618799 K\n0.813312 0.308470 0.118799 K\n0.823319 0.239004 0.795424 Ge\n0.239004 0.823319 0.295424 Ge\n0.921997 0.298311 0.558129 B\n0.298311 0.921997 0.058129 B\n0.034493 0.361694 0.360048 B\n0.361694 0.034493 0.860048 B\n0.930431 0.965307 0.345766 B\n0.965307 0.930431 0.845766 B\n0.662046 0.065852 0.409244 B\n0.065852 0.662046 0.909244 B\n0.419180 0.980720 0.402994 O\n0.980720 0.419180 0.902994 O\n0.086858 0.429673 0.479855 O\n0.429673 0.086858 0.979855 O\n0.976057 0.365704 0.668410 O\n0.365704 0.976057 0.168410 O\n0.180177 0.549178 0.283203 O\n0.549178 0.180177 0.783203 O\n0.094126 0.186988 0.337518 O\n0.186988 0.094126 0.837518 O\n0.975151 0.797411 0.322967 O\n0.797411 0.975151 0.822967 O\n0.711907 0.890824 0.376827 O\n0.890824 0.711907 0.876827 O\n0.717753 0.118365 0.531047 O\n0.118365 0.717753 0.031047 O\n0.796608 0.268736 0.341592 O\n0.268736 0.796608 0.841592 O\n0.523063 0.554254 0.136993 O\n0.554254 0.523063 0.636993 O\n0.742877 0.676531 0.606430 O\n0.676531 0.742877 0.106430 O\n",
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{
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{
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{
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}